(Q105120440)

English

6-(3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylheptanoic acid

group of stereoisomers with the chemical formula C₂₇H₄₆O₄

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Statements

instance of

group of stereoisomers

0 references

1 reference

434.339609952 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₄₆O₄

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canonical SMILES

O=C(O)C(C)CCCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C

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found in taxon

Homo sapiens

1 reference

stated in

A community-driven global reconstruction of human metabolism.

Identifiers

InChI

InChI=1S/C27H46O4/c1-16(6-5-7-17(2)25(30)31)20-8-9-21-24-22(11-13-27(20,21)4)26(3)12-10-19(28)14-18(26)15-23(24)29/h16-24,28-29H,5-15H2,1-4H3,(H,30,31)

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InChIKey

ITZYGDKGRKKBSN-UHFFFAOYSA-N

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2 references

3 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

ITZYGDKGRKKBSN-UHFFFAOYSA-N

1 reference

(Q105120440)

6-(3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylheptanoic acid

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